Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.53 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.51 |
| ▸ | TUBB | P07437 | 1/20 | 0.51 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.51 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.51 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.51 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.51 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.51 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.51 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.51 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.51 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.51 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.51 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.51 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.51 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.51 |
| ▸ | PARG | Q86W56 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL29499017 | 0.99 | ROCK2 (0.52) | ROCK2TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL29499001 | 0.83 | NPC1 (0.63) | ROCK2TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL29498997 | 0.83 | ROCK2 (0.53) | ROCK2TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL16577536 | 0.83 | ROCK2 (0.53) | ROCK2TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL25151752 | 0.82 | ROCK2 (0.52) | ROCK2TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL17786499 | 0.82 | KDM4E (0.64) | ROCK2PARGNPC1RAB9AKDM4E | |
| SCHEMBL29499007 | 0.82 | ROCK2 (0.52) | ROCK2TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL29499041 | 0.82 | NPC1 (0.66) | ROCK2TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL25151723 | 0.82 | ROCK2 (0.52) | ROCK2TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL29499003 | 0.82 | ROCK2 (0.52) | ROCK2TUBB4ATUBBTUBA3CTUBA1B |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111518039-B | Preparation method of nonmetal-promoted 2-alkyl heteroarene compound | 西安交通大学 | 2022-05-06 | — | — | CN | disclosed |